#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tz4 s PRO 2 N 0.00 2.20 -0.33 -3.48 0.04 -1.26 -5.07 135.00 127.10 1tz4 s PRO 2 Ca 0.00 0.70 -0.01 0.00 0.04 0.00 0.00 61.00 61.73 1tz4 s PRO 2 Cb 0.00 -1.93 0.19 0.00 0.04 0.00 0.00 34.50 32.80 1tz4 s PRO 2 CO 0.00 -1.55 0.81 0.45 0.04 0.00 0.00 177.00 176.74 1tz4 s SER 3 N -3.87 -1.04 0.00 6.66 0.15 -1.26 -5.03 113.70 109.31 1tz4 s SER 3 Ca 0.60 -0.15 0.00 0.00 0.70 0.00 0.00 55.95 57.10 1tz4 s SER 3 Cb -0.14 1.51 0.00 0.00 -1.71 0.00 0.00 66.02 65.67 1tz4 s SER 3 CO 0.54 -0.16 0.00 0.29 1.20 0.00 0.00 173.24 175.11 1tz4 n LYS 4 N 4.76 0.00 -2.29 5.44 4.76 -1.26 -5.15 118.16 124.43 1tz4 n LYS 4 Ca 0.08 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 55.18 1tz4 n LYS 4 Cb 0.57 0.00 -0.01 0.00 -1.84 0.00 0.00 35.03 33.76 1tz4 n LYS 4 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1tz4 s PRO 5 N 0.00 3.49 0.19 1.97 0.04 -1.26 -5.07 135.00 134.36 1tz4 s PRO 5 Ca 0.00 1.39 -0.23 0.00 0.04 0.00 0.00 61.00 62.20 1tz4 s PRO 5 Cb 0.00 -2.05 0.06 0.00 0.04 0.00 0.00 34.50 32.55 1tz4 s PRO 5 CO 0.00 -0.69 0.64 0.34 0.04 0.00 0.00 177.00 177.32 1tz4 s ASP 6 N -2.17 -0.49 0.78 6.66 2.15 -1.26 -5.16 116.67 117.18 1tz4 s ASP 6 Ca 0.68 -0.15 -0.14 0.00 0.43 0.00 0.00 52.55 53.36 1tz4 s ASP 6 Cb -0.18 0.63 0.05 0.00 -0.30 0.00 0.00 42.92 43.11 1tz4 s ASP 6 CO 0.27 -1.06 1.08 0.59 -0.17 0.00 0.00 175.17 175.88 1tz4 n ASN 7 N -0.40 0.69 -4.57 -0.34 4.13 -1.26 -4.91 115.26 108.61 1tz4 n ASN 7 Ca -0.14 0.61 -0.41 0.00 1.68 0.00 0.00 54.58 56.33 1tz4 n ASN 7 Cb 0.63 -1.46 -0.03 0.00 -1.54 0.00 0.00 39.78 37.39 1tz4 n ASN 7 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1tz4 s PRO 8 N -3.79 3.03 0.00 3.52 0.04 -1.26 -4.11 135.00 132.44 1tz4 s PRO 8 Ca 0.73 0.61 0.00 0.00 0.04 0.00 0.00 61.00 62.38 1tz4 s PRO 8 Cb -0.31 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 29.99 1tz4 s PRO 8 CO 0.51 -2.25 0.00 0.41 0.04 0.00 0.00 177.00 175.71 1tz4 n GLY 9 N 5.46 -0.89 0.00 0.56 0.00 -1.26 -4.79 105.19 104.28 1tz4 n GLY 9 Ca 0.16 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.50 1tz4 n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1tz4 n GLU 10 N 0.00 0.00 -3.09 1.61 2.13 -1.26 -5.08 120.64 114.95 1tz4 n GLU 10 Ca 0.00 0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.87 1tz4 n GLU 10 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1tz4 n GLU 10 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1tz4 s ASP 11 N -0.99 -0.44 -1.00 4.31 -1.08 -1.26 -4.94 116.67 111.27 1tz4 s ASP 11 Ca 0.00 0.01 -0.15 0.00 -0.52 0.00 0.00 52.55 51.89 1tz4 s ASP 11 Cb 0.00 1.16 0.01 0.00 -1.46 0.00 0.00 42.92 42.62 1tz4 s ASP 11 CO 0.00 -0.08 0.70 0.00 0.52 0.00 0.00 175.17 176.31 1tz4 n ALA 12 N 4.88 -2.64 -1.92 3.66 0.00 -1.26 -4.76 120.51 118.48 1tz4 n ALA 12 Ca 0.09 -0.29 -0.43 0.00 0.00 0.00 0.00 53.44 52.80 1tz4 n ALA 12 Cb 0.59 -2.38 -0.03 0.00 0.00 0.00 0.00 19.45 17.63 1tz4 n ALA 12 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1tz4 s PRO 13 N -5.57 3.35 -0.94 0.00 0.04 -1.26 -1.49 135.00 129.13 1tz4 s PRO 13 Ca 0.27 1.61 -0.02 0.00 0.04 0.00 0.00 61.00 62.90 1tz4 s PRO 13 Cb -0.12 -4.22 0.00 0.00 0.04 0.00 0.00 34.50 30.21 1tz4 s PRO 13 CO 0.88 -1.84 0.20 0.00 0.04 0.00 0.00 177.00 176.28 1tz4 n ALA 14 N 10.38 -0.47 -3.00 8.56 0.00 -1.26 -5.03 120.51 129.69 1tz4 n ALA 14 Ca 0.24 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.82 1tz4 n ALA 14 Cb 0.46 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.87 1tz4 n ALA 14 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1tz4 n GLU 15 N -2.42 2.67 0.22 0.00 2.13 -0.55 -4.94 120.64 117.75 1tz4 n GLU 15 Ca -0.10 0.00 0.15 0.00 0.66 0.00 0.00 57.16 57.87 1tz4 n GLU 15 Cb 0.59 0.00 0.80 0.00 0.27 0.00 0.00 31.44 33.09 1tz4 n GLU 15 CO 0.00 0.00 0.00 0.22 -0.41 0.00 0.00 177.13 176.94 1tz4 h ASP 16 N 0.00 0.00 -0.24 4.31 3.58 -1.96 -1.15 116.42 120.97 1tz4 h ASP 16 Ca 0.00 0.00 0.07 0.00 0.42 0.00 0.00 57.03 57.52 1tz4 h ASP 16 Cb 0.00 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 1tz4 h ASP 16 CO 0.00 0.00 0.27 0.25 -2.88 0.00 0.00 179.24 176.88 1tz4 h LEU 17 N 0.00 0.00 -2.07 2.28 5.85 -1.86 -3.00 115.31 116.51 1tz4 h LEU 17 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1tz4 h LEU 17 Cb 0.01 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1tz4 h LEU 17 CO 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.10 1tz4 n ALA 18 N -2.32 1.73 0.00 1.25 0.00 -0.44 -2.14 120.51 118.60 1tz4 n ALA 18 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1tz4 n ALA 18 Cb 0.40 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.82 1tz4 n ALA 18 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1tz4 n GLN 19 N 0.93 0.00 0.18 0.00 -0.06 -1.13 -4.86 117.38 112.44 1tz4 n GLN 19 Ca 0.00 0.00 -0.14 0.00 -2.00 0.00 0.00 57.00 54.86 1tz4 n GLN 19 Cb 0.11 -0.26 -0.07 0.00 -4.06 0.00 0.00 30.24 25.96 1tz4 n GLN 19 CO 0.00 0.00 0.00 -0.92 -0.20 0.00 0.00 177.06 175.94 1tz4 h TYR 20 N 0.00 -0.80 -0.14 3.69 3.20 -1.57 0.34 116.97 121.70 1tz4 h TYR 20 Ca 0.00 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.89 1tz4 h TYR 20 Cb 0.00 0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 1tz4 h TYR 20 CO 0.00 -0.42 0.09 0.00 -1.64 0.00 0.00 178.16 176.19 1tz4 h ALA 21 N -0.00 1.94 -0.03 1.82 0.00 -1.93 -1.61 119.26 119.45 1tz4 h ALA 21 Ca -0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1tz4 h ALA 21 Cb 0.57 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1tz4 h ALA 21 CO -0.09 0.05 -0.15 0.00 0.00 0.00 0.00 179.25 179.07 1tz4 h ALA 22 N 1.92 0.06 -0.44 0.00 0.00 -1.58 -0.95 119.26 118.26 1tz4 h ALA 22 Ca 0.05 -0.39 0.06 0.00 0.00 0.00 0.00 54.91 54.63 1tz4 h ALA 22 Cb 0.02 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1tz4 h ALA 22 CO -0.01 -0.01 0.16 0.22 0.00 0.00 0.00 179.25 179.61 1tz4 h ASP 23 N -0.45 0.17 -0.64 0.00 1.82 -0.11 0.32 116.42 117.52 1tz4 h ASP 23 Ca -0.01 0.05 -0.08 0.00 -0.39 0.00 0.00 57.03 56.60 1tz4 h ASP 23 Cb 0.81 0.03 -0.03 0.00 0.68 0.00 0.00 39.33 40.83 1tz4 h ASP 23 CO 0.03 0.13 0.09 -0.07 -1.61 0.00 0.00 179.24 177.81 1tz4 h LEU 24 N 0.33 1.04 -0.79 2.28 3.38 -1.35 1.00 115.31 121.19 1tz4 h LEU 24 Ca 0.21 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1tz4 h LEU 24 Cb 0.20 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 1tz4 h LEU 24 CO -0.21 1.05 0.47 0.03 0.09 0.00 0.00 178.44 179.87 1tz4 h ARG 25 N 1.01 1.08 -0.06 1.13 2.47 -0.55 -0.19 114.38 119.28 1tz4 h ARG 25 Ca 0.20 -0.10 -0.02 0.00 -1.26 0.00 0.00 59.98 58.79 1tz4 h ARG 25 Cb 0.46 -0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.55 1tz4 h ARG 25 CO 0.02 0.77 -0.06 1.25 0.56 0.00 0.00 179.97 182.51 1tz4 h HIS 26 N 1.09 0.17 -0.11 3.04 2.76 -0.08 -1.78 115.15 120.23 1tz4 h HIS 26 Ca 0.28 -0.05 0.05 0.00 -2.20 0.00 0.00 60.37 58.45 1tz4 h HIS 26 Cb -0.03 -0.04 -0.06 0.00 1.55 0.00 0.00 27.41 28.84 1tz4 h HIS 26 CO -0.00 0.59 -0.33 1.88 -1.30 0.00 0.00 177.93 178.76 1tz4 h TYR 27 N -0.30 -0.93 -0.78 5.26 0.05 -0.77 -0.72 116.97 118.78 1tz4 h TYR 27 Ca 0.01 0.04 0.08 0.00 0.05 0.00 0.00 58.73 58.90 1tz4 h TYR 27 Cb 0.56 0.42 -0.07 0.00 1.01 0.00 0.00 36.73 38.66 1tz4 h TYR 27 CO 0.09 -0.41 0.45 0.97 -1.05 0.00 0.00 178.16 178.21 1tz4 h ILE 28 N -0.42 0.95 -0.13 -2.88 2.10 -1.03 0.33 117.51 116.43 1tz4 h ILE 28 Ca 0.09 -0.27 -0.02 0.00 1.08 0.00 0.00 64.86 65.74 1tz4 h ILE 28 Cb 0.56 0.09 -0.01 0.00 -1.09 0.00 0.00 36.82 36.37 1tz4 h ILE 28 CO -0.35 0.14 -0.01 0.78 -1.08 0.00 0.00 178.15 177.64 1tz4 h ASN 29 N 0.79 0.16 0.10 2.19 2.35 -0.78 0.30 115.58 120.69 1tz4 h ASN 29 Ca 0.36 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 56.09 1tz4 h ASN 29 Cb 0.27 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1tz4 h ASN 29 CO -0.21 0.20 -0.05 -0.07 -1.65 0.00 0.00 177.43 175.65 1tz4 h LEU 30 N 0.18 -0.11 -0.24 1.61 3.38 0.11 -3.26 115.31 116.97 1tz4 h LEU 30 Ca 0.04 -0.44 0.02 0.00 0.09 0.00 0.00 57.88 57.59 1tz4 h LEU 30 Cb 0.14 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1tz4 h LEU 30 CO 0.00 0.54 0.09 0.40 0.09 0.00 0.00 178.44 179.56 1tz4 h ILE 31 N -0.91 0.94 -0.55 1.22 2.04 -0.20 -1.47 117.51 118.58 1tz4 h ILE 31 Ca -0.01 -0.07 0.15 0.00 1.00 0.00 0.00 64.86 65.93 1tz4 h ILE 31 Cb 0.55 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1tz4 h ILE 31 CO 0.02 0.04 0.39 0.00 0.00 0.00 0.00 178.15 178.60 1tz4 h THR 32 N 0.20 0.75 -0.00 -0.27 1.03 -0.58 0.20 112.91 114.24 1tz4 h THR 32 Ca 0.10 -0.02 0.00 0.00 -0.01 0.00 0.00 66.41 66.48 1tz4 h THR 32 Cb 0.07 0.68 0.00 0.00 -1.07 0.00 0.00 68.15 67.83 1tz4 h THR 32 CO -0.11 0.01 -0.00 -1.14 -0.01 0.00 0.00 175.52 174.28 1tz4 n ARG 33 N -4.39 1.06 -2.69 0.00 3.00 -0.56 -4.15 116.66 108.92 1tz4 n ARG 33 Ca 0.10 -0.09 -0.05 0.00 -0.00 0.00 0.00 57.85 57.82 1tz4 n ARG 33 Cb 0.58 -1.50 0.12 0.00 0.00 0.00 0.00 32.46 31.67 1tz4 n ARG 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1tz4 n GLN 34 N -0.90 1.27 -3.92 -0.14 10.64 0.56 -5.08 117.38 119.82 1tz4 n GLN 34 Ca 0.24 -1.57 -0.15 0.00 -1.83 0.00 0.00 57.00 53.68 1tz4 n GLN 34 Cb 0.13 0.15 -0.04 0.00 -0.86 0.00 0.00 30.24 29.62 1tz4 n GLN 34 CO 0.00 0.00 0.00 -2.13 -1.83 0.00 0.00 177.06 173.10 1tz4 n ARG 35 N -1.01 0.57 -0.23 2.61 0.63 -0.36 -4.90 116.66 113.98 1tz4 n ARG 35 Ca -0.09 -2.79 0.00 0.00 -0.92 0.00 0.00 57.85 54.05 1tz4 n ARG 35 Cb 0.86 2.54 0.00 0.00 0.45 0.00 0.00 32.46 36.32 1tz4 n ARG 35 CO 0.00 0.00 0.00 2.48 -2.51 0.00 0.00 177.63 177.60